[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2-(3-bromanylphenoxy)ethanoate

Systemtic Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2-(3-bromanylphenoxy)ethanoate Openeye Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl] 2-(3-bromophenoxy)acetate CAS Name: 2-(3-bromophenoxy)acetic acid [2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl] 2-(3-bromophenoxy)acetate Traditional Name: 2-(3-bromophenoxy)acetic acid [2-keto-2-(4-mesylpiperazino)ethyl] ester Formula: C15H19BrN2O6S MolecularWeight: 435.29016

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)COC(=O)COC2=CC(=CC=C2)Br

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)COC(=O)COC2=CC(=CC=C2)Br

InChI

InChI=1S/C15H19BrN2O6S/c1-25(21,22)18-7-5-17(6-8-18)14(19)10-24-15(20)11-23-13-4-2-3-12(16)9-13/h2-4,9H,5-8,10-11H2,1H3